2-[2-(1-adamantylsulfanyl)ethanoyl-methyl-amino]-N-(4-methylphenyl)ethanamide

Systemtic Name: 2-[2-(1-adamantylsulfanyl)ethanoyl-methyl-amino]-N-(4-methylphenyl)ethanamide Openeye Name: 2-[[2-(1-adamantylsulfanyl)acetyl]-methyl-amino]-N-(p-tolyl)acetamide CAS Name: 2-[[2-(1-adamantylthio)-1-oxoethyl]-methylamino]-N-(4-methylphenyl)acetamide IUPAC Name: 2-[[2-(1-adamantylsulfanyl)acetyl]-methylamino]-N-(4-methylphenyl)acetamide Traditional Name: 2-[[2-(1-adamantylthio)acetyl]-methyl-amino]-N-(p-tolyl)acetamide Formula: C22H30N2O2S MolecularWeight: 386.5508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CN(C)C(=O)CSC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CN(C)C(=O)CSC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C22H30N2O2S/c1-15-3-5-19(6-4-15)23-20(25)13-24(2)21(26)14-27-22-10-16-7-17(11-22)9-18(8-16)12-22/h3-6,16-18H,7-14H2,1-2H3,(H,23,25)